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arXiv · 1909.01024

Microwave heating and collapse of methane hydrate by molecular dynamics simulations

Motohiko Tanaka·Motoyasu Sato·Shin Nakatani
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Abstract

Microwave heating of methane hydrate is investigated with electrostatic molecular dynamics simulations by the SPC/E water model. The structure I of methane hydrate is constructed. When the methane hydrate with a density of 0.91 $\rm{g/cm}^3$ and temperature of 273 K is exposed to microwave electric fields, it suddenly collapses in liquid after a certain period of irradiation. However, a hydrate with a five percent higher density of 0.95 $\rm{g/cm}^3$ and the same initial temperature shows no collapse as a crystal caused by the microwave. A hydrate with CO$_{2}$ guest molecules has increased kinetic energy but rapidly collapses due to the Lennard-Jones potentials. The methane hydrate with variable density and temperature is presented and exhibits slow heating as a crystal and an unchanging volume.

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Motohiko Tanaka, Motoyasu Sato, Shin Nakatani. 2019-09-03. Microwave heating and collapse of methane hydrate by molecular dynamics simulations. https://arxiv.org/abs/1909.01024

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